1,3-dimethyl-1,3-diazinane;hydrochloride

C6H15ClN2 — CID 54601503

IUPAC1,3-dimethyl-1,3-diazinane;hydrochloride
SMILESCN1CCCN(C)C1.Cl
InChIInChI=1S/C6H14N2.ClH/c1-7-4-3-5-8(2)6-7;/h3-6H2,1-2H3;1H
InChIKeyYBUHTEZLEQNXSN-UHFFFAOYSA-N
MW150.65 g/mol
LogP0.63
Rot. Bonds

About 1,3-dimethyl-1,3-diazinane;hydrochloride

1,3-dimethyl-1,3-diazinane;hydrochloride (PubChem CID 54601503) has the molecular formula C6H15ClN2 and a molecular weight of 150.65 g/mol. Its IUPAC name is 1,3-dimethyl-1,3-diazinane;hydrochloride.

Molecular Properties

Compound Name1,3-dimethyl-1,3-diazinane;hydrochloride
PubChem CID54601503
Molecular FormulaC6H15ClN2
Molecular Weight150.65 g/mol
Exact Mass150.09
IUPAC Name1,3-dimethyl-1,3-diazinane;hydrochloride
SMILESCN1CCCN(C)C1.Cl
InChIInChI=1S/C6H14N2.ClH/c1-7-4-3-5-8(2)6-7;/h3-6H2,1-2H3;1H
InChIKeyYBUHTEZLEQNXSN-UHFFFAOYSA-N
XLogP0.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.65
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-1,3-diazinane;hydrochloride?
The IUPAC name of 1,3-dimethyl-1,3-diazinane;hydrochloride (CID 54601503) is 1,3-dimethyl-1,3-diazinane;hydrochloride.
What is the SMILES notation for 1,3-dimethyl-1,3-diazinane;hydrochloride?
The canonical SMILES for 1,3-dimethyl-1,3-diazinane;hydrochloride is CN1CCCN(C)C1.Cl.
What is the InChIKey of 1,3-dimethyl-1,3-diazinane;hydrochloride?
The InChIKey is YBUHTEZLEQNXSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2.ClH/c1-7-4-3-5-8(2)6-7;/h3-6H2,1-2H3;1H.
What are the key properties of 1,3-dimethyl-1,3-diazinane;hydrochloride?
1,3-dimethyl-1,3-diazinane;hydrochloride has a molecular weight of 150.65 g/mol, XLogP of 0.63, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-1,3-diazinane;hydrochloride is sourced from PubChem (CID 54601503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).